2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol

C17H31NO — CID 114339715

IUPAC2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol
SMILESOC1CCCCC1C1CCCN1CC1CCCCC1
InChIInChI=1S/C17H31NO/c19-17-11-5-4-9-15(17)16-10-6-12-18(16)13-14-7-2-1-3-8-14/h14-17,19H,1-13H2
InChIKeyMOVLTKQAPGOXKI-UHFFFAOYSA-N
MW265.44 g/mol
LogP3.58
Rot. Bonds3

About 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol

2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol (PubChem CID 114339715) has the molecular formula C17H31NO and a molecular weight of 265.44 g/mol. Its IUPAC name is 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol
PubChem CID114339715
Molecular FormulaC17H31NO
Molecular Weight265.44 g/mol
Exact Mass265.24
IUPAC Name2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol
SMILESOC1CCCCC1C1CCCN1CC1CCCCC1
InChIInChI=1S/C17H31NO/c19-17-11-5-4-9-15(17)16-10-6-12-18(16)13-14-7-2-1-3-8-14/h14-17,19H,1-13H2
InChIKeyMOVLTKQAPGOXKI-UHFFFAOYSA-N
XLogP3.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(3-cyclopentyl-2-hydroxypropyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 103161293
2-(1-ethylpiperidin-2-yl)cyclohexan-1-ol
CID 114339807
2-[1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339594
2-[1-(oxolan-2-ylmethyl)piperidin-2-yl]cyclopentan-1-ol
CID 114340035
2-[1-(2,2,2-trifluoroethyl)piperidin-2-yl]cyclohexan-1-ol
CID 114339767
2-[2-(2-hydroxycyclohexyl)piperidin-1-yl]acetonitrile
CID 114339805
2-[1-[(4-chlorophenyl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339702
2-[1-(pyrimidin-2-ylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339630
2-[1-(3-ethoxy-2-hydroxypropyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339580
N-cyclopropyl-2-[2-(2-hydroxycyclohexyl)pyrrolidin-1-yl]-N-methylacetamide
CID 114339601
2-[1-(3-methylsulfanylpropyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339633
2-[1-(2-chloroprop-2-enyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339388

Frequently Asked Questions

What is the IUPAC name of 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol?
The IUPAC name of 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol (CID 114339715) is 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol?
The canonical SMILES for 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol is OC1CCCCC1C1CCCN1CC1CCCCC1.
What is the InChIKey of 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol?
The InChIKey is MOVLTKQAPGOXKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NO/c19-17-11-5-4-9-15(17)16-10-6-12-18(16)13-14-7-2-1-3-8-14/h14-17,19H,1-13H2.
What are the key properties of 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol?
2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol has a molecular weight of 265.44 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(cyclohexylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 114339715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).